canSAR1632091
FEATURES
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NAMES
    SMILES
    CCN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=Nc1ccccc1
    InChI
    InChI=1S/C20H17N3OS/c1-2-23-19(24)18(25-20(23)22-15-8-4-3-5-9-15)12-14-13-21-17-11-7-6-10-16(14)17/h3-13,21H,2H2,1H3/b18-12+,22-20?
    MOLECULAR FORMULA
    C20H17N3OS
    CROSS REFERENCES
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    canSAR1632091
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight347.11
    AlogP4.79
    HBond donors1
    HBond acceptors4
    Atoms42
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632091.